CID 175365

72987-60-1

Structural Information

Molecular Formula
C12H22O
SMILES
CC1CC(CCC1O)C2CCCC2
InChI
InChI=1S/C12H22O/c1-9-8-11(6-7-12(9)13)10-4-2-3-5-10/h9-13H,2-8H2,1H3
InChIKey
NPNPPGCLAHDWKQ-UHFFFAOYSA-N
Compound name
4-cyclopentyl-2-methylcyclohexan-1-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

182.16707 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.17435 144.8
[M+Na]+ 205.15629 154.2
[M+NH4]+ 200.20089 154.3
[M+K]+ 221.13023 149.4
[M-H]- 181.15979 148.2
[M+Na-2H]- 203.14174 149.0
[M]+ 182.16652 146.8
[M]- 182.16762 146.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.